Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | ULK1 | O75385 | 9/20 | 0.41 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30803159 | 1.00 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL23685719 | 1.00 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL8267270 | 1.00 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL24276012 | 1.00 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| Hydrochloric Acid SCHEMBL30397156 | 0.98 | ULK1 (0.40) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| Hydrochloric Acid SCHEMBL29625161 | 0.98 | ULK1 (0.40) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL24242356 | 0.96 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL22429223 | 0.88 | CHRNB2 (0.44) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL16440235 | 0.88 | CHRNB2 (0.44) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 | |
| SCHEMBL31390191 | 0.88 | CHRNB2 (0.44) | CHRNB2CHRNA4CHRNA7ULK1SMYD3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3475277-B1 | ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF | BIOIMICS AB (SE) | 2021-10-20 | — | — | EP | disclosed |